(11E,13Z,17Z)-16-[5-(4,5-dihydroxy-6-methyloxan-2-yl)oxy-4-methoxy-6-methyloxan-2-yl]oxy-7,26-dihydroxy-6,15,17-trimethyl-5'-propan-2-ylspiro[2,21-dioxatetracyclo[18.3.2.14,8.011,26]hexacosa-5,11,13,17-tetraene-22,2'-oxane]-3-one
- InChIKey: ZETCQFVJKLCYEI-PSFZNSIOSA-N
- InChI: InChI=1S/C47H72O13/c1-25(2)31-18-19-46(54-24-31)23-34-16-15-33(60-46)14-12-27(4)43(58-40-22-38(53-8)44(30(7)56-40)59-39-21-37(48)42(50)29(6)55-39)26(3)10-9-11-32-13-17-35-41(49)28(5)20-36(45(51)57-34)47(32,35)52/h9-12,20,25-26,29-31,33-44,48-50,52H,13-19,21-24H2,1-8H3/b10-9-,27-12-,32-11+
- SMILES: CC1/C=C\C=C\2/CCC3C2(C(C=C(C3O)C)C(=O)OC4CCC(C/C=C(\C1OC5CC(C(C(O5)C)OC6CC(C(C(O6)C)O)O)OC)/C)OC7(C4)CCC(CO7)C(C)C)O
- Exact Mass: 844.49729
- Molecular Formula: C47H72O13
-
Compound CID:
154700136
154700136
Hidden Reactions Filter
Some biological reactions link very small precursors (e.g. CO₂, acetate) to much larger products.
These reactions are correct, but they can create unrealistic shortest paths and connect otherwise separate parts of the graph.
To keep the overview readable, FAIR-TPs hides six such reactions where a <60 Da precursor leads to a >300 Da product in the visualisations.
You can have all these paths in the download output.
You can have all these paths in the download output.
Hidden reaction pairs (precursor → product):
- Acetate → N-(2-benzoyl-4-chlorophenyl)-2-acetamidoacetamide
- Acetate → N-(2-benzoyl-4-chlorophenyl)-2-acetamido-n-methylacetamide
- Carbon dioxide → Formylmethanofuran
- Acrolein → Chembl3706542
- Ethylene oxide → Acetyl-coa
- Formaldehyde → S-hydroxymethylglutathione
Note: In the graph output, up to 100 compounds are displayed for faster visualization. For the full output, please use the export files.
Click on a node or edge to see details here.